(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid

C86H121Cl2N7O17 — CID 158134158

IUPAC(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid
SMILESCCCCC[C@H](NC(=O)[C@H](C)CC(=O)[C@H](CCCCC)NC(=O)[C@H](CNC(=O)OC(C)(C)C)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)O.CCCCC[C@H](NC(=O)[C@H](CN)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)C[C@@H](C)C(=O)N[C@@H](CCCCC)C(=O)C[C@@H](C)C(=O)C1CO1.C[C@H](N)C(=O)C1CO1
InChIInChI=1S/C41H56ClN3O7.C40H56ClN3O8.C5H9NO2/c1-5-7-9-11-33(36(47)21-26(3)39(49)38-25-52-38)44-40(50)27(4)22-37(48)34(12-10-8-6-2)45-41(51)31(24-43)23-35(46)30-15-13-28(14-16-30)29-17-19-32(42)20-18-29;1-7-9-11-13-32(35(46)23-26(3)36(47)44-33(38(49)50)14-12-10-8-2)43-37(48)30(25-42-39(51)52-40(4,5)6)24-34(45)29-17-15-27(16-18-29)28-19-21-31(41)22-20-28;1-3(6)5(7)4-2-8-4/h13-20,26-27,31,33-34,38H,5-12,21-25,43H2,1-4H3,(H,44,50)(H,45,51);15-22,26,30,32-33H,7-14,23-25H2,1-6H3,(H,42,51)(H,43,48)(H,44,47)(H,49,50);3-4H,2,6H2,1H3/t26-,27-,31+,33+,34+,38?;26-,30+,32+,33+;3-,4?/m110/s1
InChIKeyFTDIAFKOJDUVTI-AFTLJAIVSA-N
MW1595.85 g/mol
LogP13.28
Rot. Bonds49

About (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid

(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid (PubChem CID 158134158) has the molecular formula C86H121Cl2N7O17 and a molecular weight of 1595.85 g/mol. Its IUPAC name is (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid.

Molecular Properties

Compound Name(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid
PubChem CID158134158
Molecular FormulaC86H121Cl2N7O17
Molecular Weight1595.85 g/mol
Exact Mass1593.82
IUPAC Name(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid
SMILESCCCCC[C@H](NC(=O)[C@H](C)CC(=O)[C@H](CCCCC)NC(=O)[C@H](CNC(=O)OC(C)(C)C)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)O.CCCCC[C@H](NC(=O)[C@H](CN)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)C[C@@H](C)C(=O)N[C@@H](CCCCC)C(=O)C[C@@H](C)C(=O)C1CO1.C[C@H](N)C(=O)C1CO1
InChIInChI=1S/C41H56ClN3O7.C40H56ClN3O8.C5H9NO2/c1-5-7-9-11-33(36(47)21-26(3)39(49)38-25-52-38)44-40(50)27(4)22-37(48)34(12-10-8-6-2)45-41(51)31(24-43)23-35(46)30-15-13-28(14-16-30)29-17-19-32(42)20-18-29;1-7-9-11-13-32(35(46)23-26(3)36(47)44-33(38(49)50)14-12-10-8-2)43-37(48)30(25-42-39(51)52-40(4,5)6)24-34(45)29-17-15-27(16-18-29)28-19-21-31(41)22-20-28;1-3(6)5(7)4-2-8-4/h13-20,26-27,31,33-34,38H,5-12,21-25,43H2,1-4H3,(H,44,50)(H,45,51);15-22,26,30,32-33H,7-14,23-25H2,1-6H3,(H,42,51)(H,43,48)(H,44,47)(H,49,50);3-4H,2,6H2,1H3/t26-,27-,31+,33+,34+,38?;26-,30+,32+,33+;3-,4?/m110/s1
InChIKeyFTDIAFKOJDUVTI-AFTLJAIVSA-N
XLogP13.28
TPSA388.62 Ų
H-Bond Donors8
H-Bond Acceptors18
Rotatable Bonds49
Heavy Atoms112
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001595.85
LogP ≤ 513.28
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid with MolForge

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Related Compounds

(2S)-2-[[(2R,5S)-5-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]heptanoyl]amino]-2-methyl-4-oxodecanoyl]amino]-4-methylpentanoic acid
CID 159818166
(2R,5S,6R)-N-[(2R,5S)-9-amino-1-cyclopropyl-2-methyl-1,4-dioxononan-5-yl]-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-6-hydroxy-2-methyl-4-oxoheptanamide
CID 158121168
benzyl (2R)-2-[[(4S,7R)-4-[[(2S)-4-[4-(4-butylphenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-7-methyl-5,8-dioxo-8-[[(2R,5S)-4-oxo-2-[(1S,2S,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]decan-5-yl]amino]octanoyl]amino]-4-oxopentanoate
CID 162144170
(2S)-2-[[(2R,5S)-5-[[4-(4-butylphenyl)benzoyl]amino]-2-methyl-9-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxononanoyl]amino]-4-methylpentanoic acid
CID 158668309
lithium;(3R,6S)-10-amino-6-[[(2R,5S,6R)-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-6-hydroxy-2-methyl-4-oxoheptanoyl]amino]-3-methyl-2,5-dioxodecanoic acid;(3R,6S)-6-[[(2R,5S,6R)-5-[[(2R)-4-[4-(4-chlorophenyl)phenyl]-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-oxobutanoyl]amino]-2-methyl-6-[(2-methylpropan-2-yl)oxy]-4-oxoheptanoyl]amino]-3-methyl-10-[(2-methylpropan-2-yl)oxycarbonylamino]-2,5-dioxodecanoic acid;methane;methyl (3R,6S)-6-[[(2R,5S,6R)-5-[[(2R)-4-[4-(4-chlorophenyl)phenyl]-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-oxobutanoyl]amino]-2-methyl-6-[(2-methylpropan-2-yl)oxy]-4-oxoheptanoyl]amino]-3-methyl-10-[(2-methylpropan-2-yl)oxycarbonylamino]-2,5-dioxodecanoate;hydroxide
CID 162052691
5-(4-chlorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
CID 69069316
(2R,5S,6R)-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-butylphenyl)phenyl]-4-oxobutanoyl]amino]-N-[(2R,5S)-9-amino-2-methyl-1-(3-methyloxiran-2-yl)-1,4-dioxononan-5-yl]-6-hydroxy-2-methyl-4-oxoheptanamide
CID 158310387
[(2R,5S)-9-amino-5-[[(2R,5S)-9-amino-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-butylphenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-4-oxononanoyl]amino]-4-oxononan-2-yl]boronic acid
CID 161331191
2-[[2-amino-2-[[2-[[2-[[4-(4-chlorophenyl)benzoyl]amino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-3-(2-methylpropoxy)butanoyl]amino]acetyl]amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
CID 123296620
(2R)-2-(4-aminobutyl)-N-[(2R,3S,6R)-7-[[(5S,8R)-1-amino-8-methyl-6,9,10-trioxoundecan-5-yl]amino]-2-hydroxy-6-methyl-4,7-dioxoheptan-3-yl]-4-oxooctanamide;(2R,5S,6R)-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-N-[(5S,8R)-1-amino-8-methyl-6,9,10-trioxoundecan-5-yl]-6-hydroxy-2-methyl-4-oxoheptanamide;methane;methyl (3R,6S)-10-amino-6-[[(2R,5S,6R)-5-[[(2R)-2-(4-aminobutyl)-4-oxooctanoyl]amino]-6-hydroxy-2-methyl-4-oxoheptanoyl]amino]-3-methyl-2,5-dioxodecanoate;methyl (3R,6S)-10-amino-6-[[(2R,5S,6R)-5-[[(2S)-6-amino-2-(butylsulfonylmethyl)hexanoyl]amino]-6-hydroxy-2-methyl-4-oxoheptanoyl]amino]-3-methyl-2,5-dioxodecanoate;methyl (3R,6S)-10-amino-6-[[(2R,5S,6R)-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-6-hydroxy-2-methyl-4-oxoheptanoyl]amino]-3-methyl-2,5-dioxodecanoate
CID 160952450
[(2R,5S)-5-[[(2R,5S)-7-amino-5-[[(2R)-2-(2-aminoethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-4-oxoheptanoyl]amino]-7-methyl-4-oxooctan-2-yl]-methylborinic acid
CID 159025022
(3S)-3-amino-2-hydroxybutanamide;tert-butyl (7R)-7-[[(2R,5S)-1-[[(4S,7R)-9-amino-2,7-dimethyl-5,8,9-trioxononan-4-yl]amino]-2-methyl-9-[(2-methylpropan-2-yl)oxycarbonylamino]-1,4-dioxononan-5-yl]carbamoyl]-9-[4-(4-butylphenyl)phenyl]-9-oxononanoate;tert-butyl (7R)-7-[[(2R,5S)-1-[[(4S,7R)-9-amino-8-hydroxy-2,7-dimethyl-5,9-dioxononan-4-yl]amino]-2-methyl-9-[(2-methylpropan-2-yl)oxycarbonylamino]-1,4-dioxononan-5-yl]carbamoyl]-9-[4-(4-butylphenyl)phenyl]-9-oxononanoate;(2S)-2-[[(2R,5S)-5-[[(2R)-2-[2-[4-(4-butylphenyl)phenyl]-2-oxoethyl]-8-[(2-methylpropan-2-yl)oxy]-8-oxooctanoyl]amino]-2-methyl-9-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxononanoyl]amino]-4-methylpentanoic acid;chloro(diazenyl)diazene;deuterio(fluoro)methane
CID 157102086

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid?
The IUPAC name of (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid (CID 158134158) is (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid.
What is the SMILES notation for (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid?
The canonical SMILES for (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid is CCCCC[C@H](NC(=O)[C@H](C)CC(=O)[C@H](CCCCC)NC(=O)[C@H](CNC(=O)OC(C)(C)C)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)O.CCCCC[C@H](NC(=O)[C@H](CN)CC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)C[C@@H](C)C(=O)N[C@@H](CCCCC)C(=O)C[C@@H](C)C(=O)C1CO1.C[C@H](N)C(=O)C1CO1.
What is the InChIKey of (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid?
The InChIKey is FTDIAFKOJDUVTI-AFTLJAIVSA-N. The full InChI is InChI=1S/C41H56ClN3O7.C40H56ClN3O8.C5H9NO2/c1-5-7-9-11-33(36(47)21-26(3)39(49)38-25-52-38)44-40(50)27(4)22-37(48)34(12-10-8-6-2)45-41(51)31(24-43)23-35(46)30-15-13-28(14-16-30)29-17-19-32(42)20-18-29;1-7-9-11-13-32(35(46)23-26(3)36(47)44-33(38(49)50)14-12-10-8-2)43-37(48)30(25-42-39(51)52-40(4,5)6)24-34(45)29-17-15-27(16-18-29)28-19-21-31(41)22-20-28;1-3(6)5(7)4-2-8-4/h13-20,26-27,31,33-34,38H,5-12,21-25,43H2,1-4H3,(H,44,50)(H,45,51);15-22,26,30,32-33H,7-14,23-25H2,1-6H3,(H,42,51)(H,43,48)(H,44,47)(H,49,50);3-4H,2,6H2,1H3/t26-,27-,31+,33+,34+,38?;26-,30+,32+,33+;3-,4?/m110/s1.
What are the key properties of (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid?
(2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid has a molecular weight of 1595.85 g/mol, XLogP of 13.28, 49 rotatable bonds, 8 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S)-5-[[(2S)-2-(aminomethyl)-4-[4-(4-chlorophenyl)phenyl]-4-oxobutanoyl]amino]-2-methyl-N-[(2R,5S)-2-methyl-1-(oxiran-2-yl)-1,4-dioxodecan-5-yl]-4-oxodecanamide;(2S)-2-amino-1-(oxiran-2-yl)propan-1-one;(2S)-2-[[(2R,5S)-5-[[(2S)-4-[4-(4-chlorophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-oxobutanoyl]amino]-2-methyl-4-oxodecanoyl]amino]heptanoic acid is sourced from PubChem (CID 158134158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).